Geometry & MOs

Info

ID:	384476
PubChem CID:	134977049
Reduced:	BrOPC14H30 (1)
Stoich.:	ABCD14E30 (1)
Weight, g/mol:	426.11846
ΔH_f, kcal/mol:	-119.58
Dipole, Da:	6.8
IP(EA), eV:	-8.56(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (dicyclohexyl-iodo-methyl-lambda5-phosphanyl)formate

Drug info:

PubChemData

Smile

CCCCP(CCCC)(CCCC)(C(=O)C)Br

DOS

IR

Vibrations