Geometry & MOs

Info

ID:	131467
PubChem CID:	51210037
Reduced:	O2S2N5C17H27 (1)
Stoich.:	A2B2C5D17E27 (1)
Weight, g/mol:	297.063506
ΔH_f, kcal/mol:	-55.14
Dipole, Da:	6.78
IP(EA), eV:	-8.82(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-difluorophenyl)sulfanyl-N-(furan-2-ylmethyl)propanamide

Drug info:

PubChemData

Smile

CCCNC1=NN=C(S1)SCC(=O)NC(=O)NC(C)C2CC3CCC2C3

DOS

IR

Vibrations