Geometry & MOs

Info

ID:	347577
PubChem CID:	127272432
Reduced:	O2N3C20H27 (1)
Stoich.:	A2B3C20D27 (1)
Weight, g/mol:	370.236876
ΔH_f, kcal/mol:	-79.45
Dipole, Da:	7.23
IP(EA), eV:	-8.62(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-anilinopyrrolidin-1-yl)-[1-(pyrrolidine-1-carbonyl)piperidin-3-yl]methanone

Drug info:

PubChemData

Smile

C1CCC(C1)N2CC(CC2=O)C(=O)N3CCC(C3)NC4=CC=CC=C4

DOS

IR

Vibrations