Geometry & MOs

Info

ID:	197022
PubChem CID:	78909750
Reduced:	NO3C15H23 (1)
Stoich.:	AB3C15D23 (1)
Weight, g/mol:	255.078996
ΔH_f, kcal/mol:	-131.21
Dipole, Da:	2.79
IP(EA), eV:	-9.37(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-amino-6-methylpyrimidin-2-yl)sulfanyl-N-carbamoylpropanamide

Drug info:

PubChemData

Smile

CCOC(CNC(=O)CCC1=CC=CC=C1)OCC

DOS

IR

Vibrations