Geometry & MOs

Info

ID:	231128
PubChem CID:	87572715
Reduced:	O4C37H68 (2)
Stoich.:	A4B37C68 (2)
Weight, g/mol:	255.104799
ΔH_f, kcal/mol:	-619.83
Dipole, Da:	3.35
IP(EA), eV:	-10.2(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

triphenylen-2-ylmethanimine

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCC1=C(C(=C(C(C1(CCCCCCCCCCCCCCCC)C(=O)O)(CCCCCCCCCCCCCCCC)C(=O)O)CCCCCCCCCCCCCCCC)C(=O)O)C(=O)O

DOS

IR

Vibrations