Geometry & MOs

Info

ID:	445234
PubChem CID:	135265308
Reduced:	O5H22C25 (1)
Stoich.:	A5B22C25 (1)
Weight, g/mol:	238.185038
ΔH_f, kcal/mol:	-120.81
Dipole, Da:	2.2
IP(EA), eV:	-8.73(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[4-[(E)-prop-1-enyl]cyclohexyl]phosphinane

Drug info:

PubChemData

Smile

CC(=C)C(=O)OCC(=O)OC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CC=C(C=C3)OC

DOS

IR

Vibrations