Geometry & MOs

Info

ID:	343136
PubChem CID:	127266309
Reduced:	FO2N3C15H18 (1)
Stoich.:	AB2C3D15E18 (1)
Weight, g/mol:	345.114713
ΔH_f, kcal/mol:	-86.51
Dipole, Da:	6.91
IP(EA), eV:	-9.28(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[cyclopropyl(pyridin-4-ylmethyl)carbamoyl]amino]-5-methylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

CN(CC1CCCOC1)C(=O)NC2=C(C=CC(=C2)C#N)F

DOS

IR

Vibrations