Geometry & MOs

Info

ID:	306461
PubChem CID:	125011798
Reduced:	N5C17H27 (1)
Stoich.:	A5B17C27 (1)
Weight, g/mol:	439.294725
ΔH_f, kcal/mol:	33.47
Dipole, Da:	4.46
IP(EA), eV:	-8.74(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-3-[5,7-dimethyl-2-[(2R)-1-[(2R)-2-methylbutanoyl]pyrrolidin-2-yl]pyrazolo[1,5-a]pyrimidin-6-yl]propanamide

Drug info:

PubChemData

Smile

CCCCN1C=C(C(=N1)C)CN2CC[C@@H](C2)C3=NC=C(N3)C

DOS

IR

Vibrations