Geometry & MOs

Info

ID:	146470
PubChem CID:	53695365
Reduced:	FN4O6H11C15 (1)
Stoich.:	AB4C6D11E15 (1)
Weight, g/mol:	384.375602
ΔH_f, kcal/mol:	-195.68
Dipole, Da:	2.56
IP(EA), eV:	-8.94(-2.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-2-icos-11-en-2-ylbenzene

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)F)OC2=C(N=C(NC2=O)C3=NC(=CC(=O)N3)O)O

DOS

IR

Vibrations