Geometry & MOs

Info

ID:	413132
PubChem CID:	135086076
Reduced:	NSO4C17H21 (1)
Stoich.:	ABC4D17E21 (1)
Weight, g/mol:	346.098728
ΔH_f, kcal/mol:	-82.93
Dipole, Da:	5.83
IP(EA), eV:	-9.73(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-nitro-N-[(Z)-5-phenylpent-4-enyl]benzenesulfonamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(CCC#CCO)CCC#CCO

DOS

IR

Vibrations