Geometry & MOs

Info

ID:	392358
PubChem CID:	135014714
Reduced:	ClNSO2C16H16 (1)
Stoich.:	ABCD2E16F16 (1)
Weight, g/mol:	371.103873
ΔH_f, kcal/mol:	-38.79
Dipole, Da:	5.34
IP(EA), eV:	-9.32(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-(3-methylsulfonyloxyimino-1-phenylbutyl)propanedioate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2/C(=C/Cl)/C

DOS

IR

Vibrations