Geometry & MOs

Info

ID:	427678
PubChem CID:	135161202
Reduced:	NO2C14H17 (1)
Stoich.:	AB2C14D17 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	-9.16
Dipole, Da:	5.6
IP(EA), eV:	-8.29(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[(E)-but-2-en-2-yl]-N'-[(E)-pent-2-enoyl]carbamimidate

Drug info:

PubChemData

Smile

CCOC=NC1=CC(=C(C=C1C=C)C=C)OC

DOS

IR

Vibrations