Geometry & MOs

Info

ID:	177206
PubChem CID:	76147394
Reduced:	NSO5H17C19 (1)
Stoich.:	ABC5D17E19 (1)
Weight, g/mol:	373.080636
ΔH_f, kcal/mol:	-126.76
Dipole, Da:	2.23
IP(EA), eV:	-9.38(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylsulfanyl-N-[[5-[furan-2-yl(hydroxy)methyl]thiophen-2-yl]methyl]benzamide

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C(=O)NCC2=CC=C(S2)C(C3=CC=CO3)O

DOS

IR

Vibrations