Geometry & MOs

Info

ID:	303551
PubChem CID:	124489890
Reduced:	NO2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	437.210327
ΔH_f, kcal/mol:	-155.11
Dipole, Da:	5.19
IP(EA), eV:	-8.27(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,9R)-11-[3-(2-phenylindol-1-yl)propanoyl]-7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one

Drug info:

PubChemData

Smile

CC[C@H](C)[C@@H](C(=O)O)NC(=O)CCN1C=CC2=C1C=CC=C2OC

DOS

IR

Vibrations