Geometry & MOs

Info

ID:	140083
PubChem CID:	52643222
Reduced:	OSF2N2H16C19 (1)
Stoich.:	ABC2D2E16F19 (1)
Weight, g/mol:	387.150429
ΔH_f, kcal/mol:	-66.52
Dipole, Da:	5.45
IP(EA), eV:	-9.28(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-3-(3-ethoxyphenyl)prop-2-enoyl]-N,N-diethylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC=C(C=C2)SC(F)F)C

DOS

IR

Vibrations