Geometry & MOs

Info

ID:	178693
PubChem CID:	76368927
Reduced:	SO3N4C28H34 (1)
Stoich.:	AB3C4D28E34 (1)
Weight, g/mol:	507.252192
ΔH_f, kcal/mol:	-55.76
Dipole, Da:	3.62
IP(EA), eV:	-8.02(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1-hydroxyethyl)-4-oxo-11-phenyl-2,3,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-2-yl]-N,2-dimethylbenzamide

Drug info:

PubChemData

Smile

CC(C1C(CC2C3=C(CCN2C1=O)C4=C(N3)C(=CC=C4)C5=CC=CC=C5)N(C)C(=S)NCCOC)O

DOS

IR

Vibrations