Geometry & MOs

Info

ID:	35538
PubChem CID:	7980005
Reduced:	NOC6H9 (3)
Stoich.:	ABC6D9 (3)
Weight, g/mol:	405.135842
ΔH_f, kcal/mol:	-130.85
Dipole, Da:	4.09
IP(EA), eV:	-9.57(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(4-tert-butylbenzoyl)amino]carbamoyl]-4-methoxybenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)NNC(=O)C1=CC=C(C=C1)C(C)(C)C)NC(=O)C

DOS

IR

Vibrations