Geometry & MOs

Info

ID:	146067
PubChem CID:	53630004
Reduced:	O3N6H18C20 (1)
Stoich.:	A3B6C18D20 (1)
Weight, g/mol:	85.06534
ΔH_f, kcal/mol:	5.65
Dipole, Da:	6.4
IP(EA), eV:	-8.1(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

3-ethoxyprop-1-ene

Drug info:

PubChemData

Smile

CCC1=CC(=C2NN=C(N2C3=CC=CC4=C3C=CC=N4)NC(=O)N)C(=O)C=C1O

DOS

IR

Vibrations