Geometry & MOs

Info

ID:	66039
PubChem CID:	46488288
Reduced:	S2N3O3C21H21 (1)
Stoich.:	A2B3C3D21E21 (1)
Weight, g/mol:	286.095357
ΔH_f, kcal/mol:	-65.51
Dipole, Da:	5.26
IP(EA), eV:	-9.02(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[(6-methoxypyridin-3-yl)carbamoyl]benzoate

Drug info:

PubChemData

Smile

CC(C)SC1=C(C=CC=N1)C(=O)NCCN2C(=O)/C(=C/C3=CC=CC=C3)/SC2=O

DOS

IR

Vibrations