Geometry & MOs

Info

ID:	24968
PubChem CID:	615360
Reduced:	ClN2H15C19 (1)
Stoich.:	AB2C15D19 (1)
Weight, g/mol:	306.092376
ΔH_f, kcal/mol:	95.78
Dipole, Da:	7.18
IP(EA), eV:	-9.12(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-benzhydryl-2-chloro-1-methylpyrrole-3-carbonitrile

Drug info:

PubChemData

Smile

CN1C(=CC(=C1Cl)C#N)C(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations