Geometry & MOs

Info

ID:	3114
PubChem CID:	9171
Reduced:	H2C3 (6)
Stoich.:	A2B3 (6)
Weight, g/mol:	228.0939
ΔH_f, kcal/mol:	69.87
Dipole, Da:	0.0
IP(EA), eV:	-8.55(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

chrysene

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CC3=C2C=CC4=CC=CC=C43

DOS

IR

Vibrations