Geometry & MOs

Info

ID:	380638
PubChem CID:	134971149
Reduced:	OPN2C28H35 (1)
Stoich.:	ABC2D28E35 (1)
Weight, g/mol:	406.051029
ΔH_f, kcal/mol:	20.48
Dipole, Da:	3.96
IP(EA), eV:	-9.28(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

carbanide;1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;zirconium(2+)

Drug info:

PubChemData

Smile

C[C@@H](C1=CC=CC=C1)N2[C@@H]([C@H](N(P2=O)[C@@H](C)C3=CC=CC=C3)C(C=C)C=C)C(C=C)C=C

DOS

IR

Vibrations