Geometry & MOs

Info

ID:	406022
PubChem CID:	135076313
Reduced:	NPO4H16C19 (1)
Stoich.:	ABC4D16E19 (1)
Weight, g/mol:	246.198365
ΔH_f, kcal/mol:	-126.4
Dipole, Da:	4.69
IP(EA), eV:	-9.6(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(E)-undec-2-enoxy]benzene

Drug info:

PubChemData

Smile

C=C(C1=CC=NC=C1)OP(=O)(OC2=CC=CC=C2)OC3=CC=CC=C3

DOS

IR

Vibrations