Geometry & MOs

Info

ID:	403369
PubChem CID:	135059889
Reduced:	N3C16H19 (1)
Stoich.:	A3B16C19 (1)
Weight, g/mol:	352.215078
ΔH_f, kcal/mol:	33.43
Dipole, Da:	3.12
IP(EA), eV:	-8.18(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-hexylpyrido[3,4-b]indole-9-carboxylate

Drug info:

PubChemData

Smile

CCCCNC1=C2C3=CC=CC(=C3NC2=NC=C1)C

DOS

IR

Vibrations