Geometry & MOs

Info

ID:	391345
PubChem CID:	135004437
Reduced:	NPO3C27H32 (1)
Stoich.:	ABC3D27E32 (1)
Weight, g/mol:	405.118469
ΔH_f, kcal/mol:	-111.68
Dipole, Da:	4.03
IP(EA), eV:	-9.46(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1-benzyl-6-methyl-2-phenyl-2H-quinolin-3-yl)-methoxymethylidene]chromium

Drug info:

PubChemData

Smile

CCCCCC[C@H]([C@H](C(=O)C1=CC=CC=C1)O)NP(=O)(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations