Geometry & MOs

Info

ID:	404625
PubChem CID:	135067975
Reduced:	N2C21H22 (1)
Stoich.:	A2B21C22 (1)
Weight, g/mol:	306.153227
ΔH_f, kcal/mol:	72.99
Dipole, Da:	3.38
IP(EA), eV:	-8.05(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-2-benzyl-4-ethenyl-6-fluoro-1,3,4,9-tetrahydropyrido[3,4-b]indole

Drug info:

PubChemData

Smile

CC1=C2C3=C(CN(C[C@@H](C3=CN2)C=C)CC4=CC=CC=C4)C=C1

DOS

IR

Vibrations