Geometry & MOs

Info

ID:	401428
PubChem CID:	135051236
Reduced:	NaSO2H7C8 (1)
Stoich.:	ABC2D7E8 (1)
Weight, g/mol:	289.086956
ΔH_f, kcal/mol:	-88.13
Dipole, Da:	4.11
IP(EA), eV:	-7.32(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-N-(2-chlorophenyl)-2-methoxyacetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1[S-])C=O.[Na+]

DOS

IR

Vibrations