Geometry & MOs

Info

ID:	193194
PubChem CID:	78355019
Reduced:	O2N4C25H40 (1)
Stoich.:	A2B4C25D40 (1)
Weight, g/mol:	388.120526
ΔH_f, kcal/mol:	-111.56
Dipole, Da:	8.74
IP(EA), eV:	-9.12(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methoxy-4-[[(4-methyl-6-oxo-1,3-diazinan-2-yl)hydrazinylidene]methyl]phenyl] thiophene-2-carboxylate

Drug info:

PubChemData

Smile

CCC1=CC=C(C=C1)C(=O)N(CCCCCCN)C(C)C2NC3CCCCC3C(=O)N2

DOS

IR

Vibrations