Geometry & MOs

Info

ID:	251494
PubChem CID:	103104394
Reduced:	ON5C10H17 (1)
Stoich.:	AB5C10D17 (1)
Weight, g/mol:	279.20591
ΔH_f, kcal/mol:	-20.77
Dipole, Da:	2.58
IP(EA), eV:	-8.99(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[ethyl-[2-propan-2-yl-6-(propylamino)pyrimidin-4-yl]amino]acetamide

Drug info:

PubChemData

Smile

CCNC1=NC=CC(=N1)N(CC)CC(=O)N

DOS

IR

Vibrations