Geometry & MOs

Info

ID:	131132
PubChem CID:	51160941
Reduced:	SN2O4C19H22 (1)
Stoich.:	AB2C4D19E22 (1)
Weight, g/mol:	320.173607
ΔH_f, kcal/mol:	-121.27
Dipole, Da:	4.73
IP(EA), eV:	-8.78(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(cyclohexylamino)-2-oxoethyl]-3,4-dimethoxybenzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)C(=O)N3CCCC3

DOS

IR

Vibrations