Geometry & MOs

Info

ID:	426470
PubChem CID:	135144317
Reduced:	N2C49H50 (1)
Stoich.:	A2B49C50 (1)
Weight, g/mol:	369.24565
ΔH_f, kcal/mol:	92.87
Dipole, Da:	2.88
IP(EA), eV:	-8.62(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-decylbenzo[c]acridine

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C(C4=CC=CC=C4N=C32)CCCCCCCCCCCCCCCC5=C6C=CC7=CC=CC=C7C6=NC8=CC=CC=C85

DOS

IR

Vibrations