Geometry & MOs

Info

ID:	206516
PubChem CID:	80263876
Reduced:	OSN3H15C16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	228.101111
ΔH_f, kcal/mol:	25.88
Dipole, Da:	5.35
IP(EA), eV:	-8.83(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-4-methyl-N-pyrimidin-2-ylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(=O)NC2=NC3=CC=CC=C3S2)NC

DOS

IR

Vibrations