Geometry & MOs

Info

ID:	357030
PubChem CID:	127293099
Reduced:	O2N4C21H28 (1)
Stoich.:	A2B4C21D28 (1)
Weight, g/mol:	363.171355
ΔH_f, kcal/mol:	-28.69
Dipole, Da:	7.02
IP(EA), eV:	-8.67(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-[1-[(1-cyclopentylpyrrolidin-3-yl)amino]-1-oxopropan-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)N2C=CC(=N2)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations