Geometry & MOs

Info

ID:	425890
PubChem CID:	135129360
Reduced:	ClSN7O8C34H46 (1)
Stoich.:	ABC7D8E34F46 (1)
Weight, g/mol:	588.256549
ΔH_f, kcal/mol:	-303.43
Dipole, Da:	8.58
IP(EA), eV:	-8.15(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[9-(2,3-dihydrophenanthren-2-yl)-4b,8a-dihydrocarbazol-2-yl]-9-phenylcarbazole

Drug info:

PubChemData

Smile

CC1=CSC2C1C3=C(C=C2OCCN(CCNC=O)C(=O)CNC(=O)CNC(=O)CNC(=O)CCCCCN4C(=O)C=CC4=O)N(CC3CCl)C

DOS

IR

Vibrations