Geometry & MOs

Info

ID:	24123
PubChem CID:	607928
Reduced:	NO2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	358.189257
ΔH_f, kcal/mol:	-149.2
Dipole, Da:	4.15
IP(EA), eV:	-8.34(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-ethyl-1-(4-methoxy-4-oxobutyl)-4,9-dihydro-3H-pyrido[3,4-b]indole-1-carboxylate

Drug info:

PubChemData

Smile

CCN1CCC2=C(C1(CCCC(=O)OC)C(=O)OC)NC3=CC=CC=C23

DOS

IR

Vibrations