Geometry & MOs

Info

ID:	170637
PubChem CID:	75262023
Reduced:	O2N5C19H25 (1)
Stoich.:	A2B5C19D25 (1)
Weight, g/mol:	354.169191
ΔH_f, kcal/mol:	-43.51
Dipole, Da:	6.28
IP(EA), eV:	-9.04(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-6-(6-methyl-1,3,4,5-tetrahydropyrido[4,3-b]indole-2-carbonyl)-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CCC1C(CC(C(=O)N1)C(=O)NC2=CC(=NN2CC3=CC=NC=C3)C)C

DOS

IR

Vibrations