Geometry & MOs

Info

ID:	182413
PubChem CID:	76887294
Reduced:	SN3O3C14H23 (1)
Stoich.:	AB3C3D14E23 (1)
Weight, g/mol:	276.12224
ΔH_f, kcal/mol:	-134.34
Dipole, Da:	6.08
IP(EA), eV:	-8.63(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-(2-cyano-4-nitrophenyl)-3,3-dimethylbutanamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)NC(=O)C(C(C)(C)C)N)NS(=O)(=O)C

DOS

IR

Vibrations