Geometry & MOs

Info

ID:	69774
PubChem CID:	47205362
Reduced:	ON2C6H9 (2)
Stoich.:	AB2C6D9 (2)
Weight, g/mol:	238.142976
ΔH_f, kcal/mol:	-58.2
Dipole, Da:	6.06
IP(EA), eV:	-9.15(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-methoxypropyl)-3-(pyrimidin-2-ylamino)propanamide

Drug info:

PubChemData

Smile

C1CC(OC1)CNC(=O)CCNC2=NC=CC=N2

DOS

IR

Vibrations