Geometry & MOs

Info

ID:	352979
PubChem CID:	127284070
Reduced:	O2N3C23H37 (1)
Stoich.:	A2B3C23D37 (1)
Weight, g/mol:	315.169525
ΔH_f, kcal/mol:	-104.65
Dipole, Da:	1.79
IP(EA), eV:	-8.56(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-2-(5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidin-6-yl)acetamide

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CC(C)NC(=O)C(C2=CC=CC=C2)N3CCC(CC3)O)C

DOS

IR

Vibrations