Geometry & MOs

Info

ID:	297222
PubChem CID:	117613530
Reduced:	O2F3N4C24H29 (1)
Stoich.:	A2B3C4D24E29 (1)
Weight, g/mol:	381.166411
ΔH_f, kcal/mol:	-213.95
Dipole, Da:	3.59
IP(EA), eV:	-8.83(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-hydroxyethyl-[2-[7-methyl-1-(trifluoromethyl)pyrido[3,4-b]indol-9-yl]ethyl]amino]ethanol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C3=C(N2CCN4CCN(CC4)C(=O)OC(C)(C)C)C(=NC=C3)C(F)(F)F

DOS

IR

Vibrations