Geometry & MOs

Info

ID:	373236
PubChem CID:	131312038
Reduced:	NC7H12 (2)
Stoich.:	AB7C12 (2)
Weight, g/mol:	226.041213
ΔH_f, kcal/mol:	-13.35
Dipole, Da:	3.12
IP(EA), eV:	-9.3(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[cyano(hydroxy)methyl]phenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=NC=C1CN)C(C)(C)C

DOS

IR

Vibrations