Geometry & MOs

Info

ID:	367395
PubChem CID:	127324427
Reduced:	ClO2N3C20H26 (1)
Stoich.:	AB2C3D20E26 (1)
Weight, g/mol:	386.231791
ΔH_f, kcal/mol:	-57.74
Dipole, Da:	1.56
IP(EA), eV:	-9.04(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-4-[2-(3-methoxyphenyl)acetyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)N3CCC(CC3)C(=O)C4=CC=C(C=C4)Cl

DOS

IR

Vibrations