Geometry & MOs

Info

ID:	37026
PubChem CID:	8016266
Reduced:	NO6C21H23 (1)
Stoich.:	AB6C21D23 (1)
Weight, g/mol:	359.163377
ΔH_f, kcal/mol:	-243.78
Dipole, Da:	12.88
IP(EA), eV:	-9.14(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-2'-butanoylspiro[1H-indole-3,1'-4,9-dihydro-3H-pyrido[3,4-b]indole]-2-one

Drug info:

PubChemData

Smile

CC[C@@H](C(=O)O)NC(=O)CC1=C(C2=C(C=C(C3=C2OC(=C3C)C)C)OC1=O)C

DOS

IR

Vibrations