Geometry & MOs

Info

ID:	306333
PubChem CID:	125003800
Reduced:	SN4O5C20H30 (1)
Stoich.:	AB4C5D20E30 (1)
Weight, g/mol:	437.279075
ΔH_f, kcal/mol:	-189.74
Dipole, Da:	2.76
IP(EA), eV:	-9.31(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(3S)-1-(cyclopropanecarbonyl)pyrrolidin-3-yl]-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]-1-(4-methylpiperidin-1-yl)propan-1-one

Drug info:

PubChemData

Smile

CC(=O)N1CCN([C@H](C1)C(=O)N(C)C)C(=O)CCC2=CC=C(C=C2)S(=O)(=O)N(C)C

DOS

IR

Vibrations