Geometry & MOs

Info

ID:	418472
PubChem CID:	135105038
Reduced:	FNOSC15H18 (1)
Stoich.:	ABCDE15F18 (1)
Weight, g/mol:	255.140533
ΔH_f, kcal/mol:	-44.05
Dipole, Da:	4.71
IP(EA), eV:	-8.74(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-ethylsulfanyl-N-[1-(1-methylimidazol-2-yl)butyl]acetamide

Drug info:

PubChemData

Smile

C1CC1CSCC(=O)N2CCC2C3=CC=C(C=C3)F

DOS

IR

Vibrations