Geometry & MOs

Info

ID:	34791
PubChem CID:	7978940
Reduced:	SO2N3C19H23 (1)
Stoich.:	AB2C3D19E23 (1)
Weight, g/mol:	347.110376
ΔH_f, kcal/mol:	-17.23
Dipole, Da:	5.22
IP(EA), eV:	-8.55(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-benzyl-1-[[2-(2-fluorophenoxy)acetyl]amino]-1-methylthiourea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)OCCC(=O)NN(C)C(=S)NCC2=CC=CC=C2

DOS

IR

Vibrations