Geometry & MOs

Info

ID:	326535
PubChem CID:	126687735
Reduced:	INOC8H14 (1)
Stoich.:	ABCD8E14 (1)
Weight, g/mol:	530.37331
ΔH_f, kcal/mol:	-46.76
Dipole, Da:	3.13
IP(EA), eV:	-8.66(-1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[[[2-[[6-(2,7-dimethyl-3-propyl-3H-indol-5-yl)-5-methyl-2,3-dihydropyridin-2-yl]amino]-2,3-dihydropyridin-5-yl]amino]methyl]piperidin-1-yl]ethanol

Drug info:

PubChemData

Smile

C1CC2(CCN(CC2)I)OC1

DOS

IR

Vibrations