Geometry & MOs

Info

ID:	323727
PubChem CID:	126675846
Reduced:	N2C5H7 (4)
Stoich.:	A2B5C7 (4)
Weight, g/mol:	567.40763
ΔH_f, kcal/mol:	81.79
Dipole, Da:	4.03
IP(EA), eV:	-8.13(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,6-ditert-butyl-9-[5-octyl-2-(oxan-2-yloxy)phenyl]carbazole

Drug info:

PubChemData

Smile

C1CN(CCN1)C2=CC=CC(=C2)CN=C/C(=C\N)/CC3=CC(=NC(=C3N)N)N

DOS

IR

Vibrations