Geometry & MOs

Info

ID:	61162
PubChem CID:	26706501
Reduced:	N3O4C23H23 (1)
Stoich.:	A3B4C23D23 (1)
Weight, g/mol:	473.198442
ΔH_f, kcal/mol:	-107.39
Dipole, Da:	5.75
IP(EA), eV:	-9.26(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-butan-2-yl]-2-[[(E)-3-[4-methoxy-3-(propan-2-ylsulfamoyl)phenyl]prop-2-enoyl]amino]benzamide

Drug info:

PubChemData

Smile

CC[C@H](C)NC(=O)C1=CC=CC=C1NC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

DOS

IR

Vibrations