Geometry & MOs

Info

ID:	20229
PubChem CID:	582758
Reduced:	NOC14H15 (1)
Stoich.:	ABC14D15 (1)
Weight, g/mol:	213.115364
ΔH_f, kcal/mol:	-12.62
Dipole, Da:	2.59
IP(EA), eV:	-8.53(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5,7,8,9,10,11-hexahydrocycloocta[b]indol-6-one

Drug info:

PubChemData

Smile

C1CCC2=C(C(=O)CC1)NC3=CC=CC=C23

DOS

IR

Vibrations