Geometry & MOs

Info

ID:	147206
PubChem CID:	53786860
Reduced:	ClO3N6C17H27 (1)
Stoich.:	AB3C6D17E27 (1)
Weight, g/mol:	358.169782
ΔH_f, kcal/mol:	-111.9
Dipole, Da:	5.21
IP(EA), eV:	-8.27(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-cyclohexyl-1,3-diphenylpropan-2-yl)phosphonic acid

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)OC2=C3C(C(=O)N2C4CCC(CN4)Cl)NCCN3

DOS

IR

Vibrations