Geometry & MOs

Info

ID:	398796
PubChem CID:	135035459
Reduced:	ClOC9H9 (1)
Stoich.:	ABC9D9 (1)
Weight, g/mol:	195.079647
ΔH_f, kcal/mol:	-14.31
Dipole, Da:	4.44
IP(EA), eV:	-8.86(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-1H-pyrrolo[1,2-a]indole-2-carbonitrile

Drug info:

PubChemData

Smile

COC=CC1=CC(=CC=C1)Cl

DOS

IR

Vibrations