Geometry & MOs

Info

ID:	42338
PubChem CID:	8149451
Reduced:	SN3O4C18H21 (1)
Stoich.:	AB3C4D18E21 (1)
Weight, g/mol:	376.133102
ΔH_f, kcal/mol:	-117.17
Dipole, Da:	4.85
IP(EA), eV:	-9.13(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

[(2R)-1-(3-acetylanilino)-1-oxopropan-2-yl]-[(4-sulfamoylphenyl)methyl]azanium

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=CC(=C1)C(=O)C)NCC2=CC=C(C=C2)S(=O)(=O)N

DOS

IR

Vibrations