Geometry & MOs

Info

ID:	199544
PubChem CID:	79264875
Reduced:	SN2O4C14H20 (1)
Stoich.:	AB2C4D14E20 (1)
Weight, g/mol:	334.002635
ΔH_f, kcal/mol:	-165.16
Dipole, Da:	1.67
IP(EA), eV:	-9.57(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-chloro-4-nitrophenyl)sulfonyl-prop-2-enylamino]acetic acid

Drug info:

PubChemData

Smile

CC(C)(C)N(CC(=O)O)C(=O)CCNC(=O)C1=CC=CS1

DOS

IR

Vibrations