Geometry & MOs

Info

ID:	74077
PubChem CID:	48421427
Reduced:	O2N4C23H30 (1)
Stoich.:	A2B4C23D30 (1)
Weight, g/mol:	385.247775
ΔH_f, kcal/mol:	-23.94
Dipole, Da:	6.68
IP(EA), eV:	-8.54(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2,5-dimethylpyrrolidin-1-yl)-N-[3-(2-oxoimidazolidin-1-yl)phenyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CCC(N1C2CCCN(C2)C(=O)C(=O)C3=NC=CN3CC4=CC=CC=C4)C

DOS

IR

Vibrations