Geometry & MOs

Info

ID:	227344
PubChem CID:	87561383
Reduced:	N3O4C32H61 (1)
Stoich.:	A3B4C32D61 (1)
Weight, g/mol:	380.188863
ΔH_f, kcal/mol:	-241.96
Dipole, Da:	9.08
IP(EA), eV:	-9.54(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5-bis(4-methylphenyl)-1,3,4,9-tetrahydropyrido[3,4-b]indole-2-carbaldehyde

Drug info:

PubChemData

Smile

CCCCCCCC/C=C\CCCCCCCCCCCCC(NC=O)[N+](C)(C)C(CCC)(C(=O)[O-])NC=O

DOS

IR

Vibrations