Geometry & MOs

Info

ID:	354210
PubChem CID:	127286174
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	373.236542
ΔH_f, kcal/mol:	-107.53
Dipole, Da:	2.29
IP(EA), eV:	-8.62(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(oxolan-2-ylmethoxy)phenyl]-2-(pyrrolidin-1-ylmethyl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)N2CCN3CCCCC3C2)N4CCCC4=O

DOS

IR

Vibrations