Geometry & MOs

Info

ID:	127972
PubChem CID:	51025283
Reduced:	NO2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	336.150764
ΔH_f, kcal/mol:	-148.11
Dipole, Da:	4.66
IP(EA), eV:	-8.98(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1S,2S,4R)-2-bicyclo[2.2.1]heptanyl]-N-(2,3-dimethyl-5-sulfamoylphenyl)acetamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)NCN2C(=O)[C@@H]3[C@@H]4CC[C@H](C4)[C@H]3C2=O

DOS

IR

Vibrations