Geometry & MOs

Info

ID:	29931
PubChem CID:	838308
Reduced:	NO3H17C18 (1)
Stoich.:	AB3C17D18 (1)
Weight, g/mol:	305.04153
ΔH_f, kcal/mol:	-79.91
Dipole, Da:	5.57
IP(EA), eV:	-8.9(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(2-bromoethyl)-6-methyl-3,4-dihydro-2H-carbazol-1-one

Drug info:

PubChemData

Smile

CCC1=CC2=C(C=C1)NC(=O)[C@]2(CC(=O)C3=CC=CC=C3)O

DOS

IR

Vibrations