Geometry & MOs

Info

ID:	403368
PubChem CID:	135059887
Reduced:	N2O5C26H28 (1)
Stoich.:	A2B5C26D28 (1)
Weight, g/mol:	253.157898
ΔH_f, kcal/mol:	-121.71
Dipole, Da:	7.18
IP(EA), eV:	-8.55(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-8-methyl-9H-pyrido[2,3-b]indol-4-amine

Drug info:

PubChemData

Smile

CCCCN1C2=CC=CC=C2C3=CC(=NC(=C31)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)OC

DOS

IR

Vibrations