Geometry & MOs

Info

ID:	407512
PubChem CID:	135080257
Reduced:	SO2N3H9C10 (1)
Stoich.:	AB2C3D9E10 (1)
Weight, g/mol:	196.100048
ΔH_f, kcal/mol:	62.71
Dipole, Da:	5.97
IP(EA), eV:	-8.83(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridine

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=C(C(=CN=C1C#C)C#C)N

DOS

IR

Vibrations