Geometry & MOs

Info

ID:	322600
PubChem CID:	126670623
Reduced:	SO2N3C16H21 (1)
Stoich.:	AB2C3D16E21 (1)
Weight, g/mol:	330.186101
ΔH_f, kcal/mol:	-48.12
Dipole, Da:	5.97
IP(EA), eV:	-8.05(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,5-dimethyl-10-oxo-2,10-di(propan-2-yl)pyrrolo[2,1-b][3,1]benzazaphosphinin-1-amine

Drug info:

PubChemData

Smile

CC(C)C1=CN2C(=C1N)N(C3=CC=CC=C3S2(=O)=O)C(C)C

DOS

IR

Vibrations