Geometry & MOs

Info

ID:	367414
PubChem CID:	127324576
Reduced:	O2N5C20H35 (1)
Stoich.:	A2B5C20D35 (1)
Weight, g/mol:	376.166604
ΔH_f, kcal/mol:	-82.11
Dipole, Da:	3.36
IP(EA), eV:	-8.93(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-chlorobenzoyl)-N-(1-cyclopropylpyrrolidin-3-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CCCN(CC1)C(=O)CN2CCN(CC2)C(=O)NC3CCN(C3)C4CC4

DOS

IR

Vibrations