Geometry & MOs

Info

ID:	210305
PubChem CID:	80787440
Reduced:	ON4C12H20 (1)
Stoich.:	AB4C12D20 (1)
Weight, g/mol:	223.14331
ΔH_f, kcal/mol:	-34.91
Dipole, Da:	4.37
IP(EA), eV:	-8.46(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(methylamino)pyrimidin-4-yl]amino]-N-propylacetamide

Drug info:

PubChemData

Smile

CCCNC(=O)CNC1=CC=CC(=N1)NCC

DOS

IR

Vibrations