Geometry & MOs

Info

ID:	244016
PubChem CID:	99309304
Reduced:	O4N5C27H31 (1)
Stoich.:	A4B5C27D31 (1)
Weight, g/mol:	425.195071
ΔH_f, kcal/mol:	-102.92
Dipole, Da:	4.68
IP(EA), eV:	-8.98(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[[1-[2-(3-methoxyphenyl)acetyl]piperidin-4-yl]amino]-2-oxoethoxy]benzamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CC(=O)N2CCC(CC2)NC(=O)C3=CC(=CC=C3)NC(=O)CCN4C=CN=C4

DOS

IR

Vibrations