Geometry & MOs

Info

ID:	217619
PubChem CID:	85088111
Reduced:	SN4O5C16H22 (1)
Stoich.:	AB4C5D16E22 (1)
Weight, g/mol:	382.065714
ΔH_f, kcal/mol:	-118.28
Dipole, Da:	2.89
IP(EA), eV:	-8.84(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[butoxy-(2-nitrophenyl)-lambda4-sulfanylidene]benzenesulfonamide

Drug info:

PubChemData

Smile

CC(=O)N(CCCCCN(C(=O)C1CSC(=C2C(=O)C=CC=N2)N1)O)O

DOS

IR

Vibrations