Geometry & MOs

Info

ID:	78769
PubChem CID:	49718205
Reduced:	N2O5C16H22 (1)
Stoich.:	A2B5C16D22 (1)
Weight, g/mol:	326.103335
ΔH_f, kcal/mol:	-188.86
Dipole, Da:	4.26
IP(EA), eV:	-8.31(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-(3-chloro-4-methoxyphenyl)-N-[(1-hydroxycyclopentyl)methyl]oxamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)NC(=O)C(=O)NCC2(CCCC2)O)OC

DOS

IR

Vibrations