Geometry & MOs

Info

ID:	296272
PubChem CID:	117564959
Reduced:	NOC7H8 (2)
Stoich.:	ABC7D8 (2)
Weight, g/mol:	294.00039
ΔH_f, kcal/mol:	-22.72
Dipole, Da:	3.43
IP(EA), eV:	-9.16(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-4-methylphenyl)-3-cyanooxetane-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=CC=C1NC(=O)C2(COC2)C#N

DOS

IR

Vibrations