Geometry & MOs

Info

ID:	392017
PubChem CID:	135012003
Reduced:	NH19C24 (1)
Stoich.:	AB19C24 (1)
Weight, g/mol:	360.151726
ΔH_f, kcal/mol:	96.81
Dipole, Da:	1.85
IP(EA), eV:	-9.01(0.02)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

diphenyl-[(5Z)-5-(4-propan-2-yl-1,3-oxazolidin-3-id-2-ylidene)cyclopenta-1,3-dien-1-yl]phosphane

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)C2=CC=CC=C2)C3=CC=CC=N3)C4=CC=CC=C4

DOS

IR

Vibrations