Geometry & MOs

Info

ID:	344290
PubChem CID:	127267466
Reduced:	O2N3F4H13C15 (1)
Stoich.:	A2B3C4D13E15 (1)
Weight, g/mol:	349.109627
ΔH_f, kcal/mol:	-188.2
Dipole, Da:	3.4
IP(EA), eV:	-8.87(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[(dimethylamino-methyl-oxo-lambda6-sulfanylidene)carbamoyl]phenyl]-2-methylfuran-3-carboxamide

Drug info:

PubChemData

Smile

C1CCOC(C1)N2C=C(C=N2)NC(=O)C3=CC(=C(C(=C3F)F)F)F

DOS

IR

Vibrations