Geometry & MOs

Info

ID:	186580
PubChem CID:	77447689
Reduced:	IO5C22H37 (1)
Stoich.:	AB5C22D37 (1)
Weight, g/mol:	473.22339
ΔH_f, kcal/mol:	-255.97
Dipole, Da:	3.85
IP(EA), eV:	-9.91(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-chloro-1'-[3-(4-methylphenyl)prop-2-enyl]spiro[2H-indole-3,4'-piperidine]-1-yl]-(2-methyl-1,2-dihydropyridin-4-yl)methanone

Drug info:

PubChemData

Smile

C1CC(C(CC1C=CC2CC(CC(C2)O)C=CCCC(C(CCI)O)O)O)O

DOS

IR

Vibrations