Geometry & MOs

Info

ID:	382640
PubChem CID:	134973915
Reduced:	OC15H24 (2)
Stoich.:	AB15C24 (2)
Weight, g/mol:	607.10125
ΔH_f, kcal/mol:	-157.72
Dipole, Da:	2.86
IP(EA), eV:	-9.25(0.88)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

[2-[[(3S,4S)-3-[(2-azanidylcarbonylphenoxy)methyl]-2,5-diphenyl-3,4-dihydropyrazol-4-yl]methoxy]benzoyl]azanide;yttrium

Drug info:

PubChemData

Smile

C[C@H](CCC(=C)C(C)C)[C@H]1CCC2[C@@]1(CCC3C2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C

DOS

IR

Vibrations