Geometry & MOs

Info

ID:	309542
PubChem CID:	126547578
Reduced:	OSN4C24H30 (1)
Stoich.:	ABC4D24E30 (1)
Weight, g/mol:	141.078979
ΔH_f, kcal/mol:	56.17
Dipole, Da:	5.1
IP(EA), eV:	-8.68(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-4-imino-2-methylbut-2-enoate

Drug info:

PubChemData

Smile

CCC/C(=C\C(C)C#CC(=N)C1C=CC(=CC1N)SC2=CC=CC=C2C(=O)NC)/N

DOS

IR

Vibrations