Geometry & MOs

Info

ID:	129600
PubChem CID:	51073248
Reduced:	O3N4C18H24 (1)
Stoich.:	A3B4C18D24 (1)
Weight, g/mol:	343.189592
ΔH_f, kcal/mol:	-124.25
Dipole, Da:	5.95
IP(EA), eV:	-9.45(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-acetylpiperidin-4-yl)-1-(furan-2-ylmethyl)-2,5-dimethylpyrrole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)NC(=C1CCC(=O)NC2CCN(CC2)C(=O)C)C)C#N

DOS

IR

Vibrations