Geometry & MOs

Info

ID:	130142
PubChem CID:	51075047
Reduced:	O2S2N3H15C16 (1)
Stoich.:	A2B2C3D15E16 (1)
Weight, g/mol:	326.13789
ΔH_f, kcal/mol:	18.64
Dipole, Da:	3.9
IP(EA), eV:	-8.4(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-carbamoylphenyl)-6-morpholin-4-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CS(=O)CC1=CC(=CC=C1)C(=O)NC2=NC(=CS2)C3=CC=CN3

DOS

IR

Vibrations