Geometry & MOs

Info

ID:	22816
PubChem CID:	598787
Reduced:	NC12H13 (1)
Stoich.:	AB12C13 (1)
Weight, g/mol:	171.104799
ΔH_f, kcal/mol:	53.27
Dipole, Da:	1.67
IP(EA), eV:	-9.39(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-5-phenylpyrrole

Drug info:

PubChemData

Smile

CC1(C=CC(=N1)C2=CC=CC=C2)C

DOS

IR

Vibrations