Geometry & MOs

Info

ID:	58330
PubChem CID:	24697817
Reduced:	F2N2O2H14C15 (1)
Stoich.:	A2B2C2D14E15 (1)
Weight, g/mol:	238.077599
ΔH_f, kcal/mol:	-153.05
Dipole, Da:	2.61
IP(EA), eV:	-8.26(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-carbamothioyl-N-(2-methoxyethyl)benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)OC(F)F)N

DOS

IR

Vibrations