Geometry & MOs

Info

ID:	195335
PubChem CID:	78674618
Reduced:	N2O4C23H28 (1)
Stoich.:	A2B4C23D28 (1)
Weight, g/mol:	402.172562
ΔH_f, kcal/mol:	-97.35
Dipole, Da:	1.94
IP(EA), eV:	-8.1(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-[(2-ethyl-6-methylphenyl)carbamothioyl]hydrazinyl]-3-methyl-1-oxobutan-2-yl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCN1CC(OC2=CC=CC=C21)CN(C)C(=O)C=CC3=C(C(=CC=C3)OC)OC

DOS

IR

Vibrations