Geometry & MOs

Info

ID:	148089
PubChem CID:	53787751
Reduced:	O3N8C40H54 (1)
Stoich.:	A3B8C40D54 (1)
Weight, g/mol:	284.049972
ΔH_f, kcal/mol:	-13.71
Dipole, Da:	5.49
IP(EA), eV:	-8.37(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[chloro(octyl)phosphoryl]prop-2-enoyl chloride

Drug info:

PubChemData

Smile

CCOCCN1C2=CC=CC=C2N=C1NC3CCN(CC3)CCC4(CCN(C4)C(=O)C5=C(C=CC(=C5)N6C(CN(N6)C)C)OC)C7=CC=CC=C7

DOS

IR

Vibrations