Geometry & MOs

Info

ID:	378483
PubChem CID:	134224567
Reduced:	O3N4C25H26 (1)
Stoich.:	A3B4C25D26 (1)
Weight, g/mol:	182.044796
ΔH_f, kcal/mol:	-7.34
Dipole, Da:	7.17
IP(EA), eV:	-8.14(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2,2-bis(phosphanyl)pentane-1-thiol

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)N=C2C=C3C4=CC(=C(C=C4CCN3C(=N2)OCC#N)OC)OC)C

DOS

IR

Vibrations