Geometry & MOs

Info

ID:	387160
PubChem CID:	134984236
Reduced:	NSO3C19H23 (1)
Stoich.:	ABC3D19E23 (1)
Weight, g/mol:	138.079313
ΔH_f, kcal/mol:	-82.27
Dipole, Da:	4.85
IP(EA), eV:	-8.87(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethylazetidine-1-carbonyl cyanide

Drug info:

PubChemData

Smile

C[C@@H]1[C@H](N([C@H]1C2=CC=C(C=C2)OC)S(=O)(=O)C)C3=CC=C(C=C3)C

DOS

IR

Vibrations