Geometry & MOs

Info

ID:	287722
PubChem CID:	104252814
Reduced:	ON3C15H25 (1)
Stoich.:	AB3C15D25 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	-49.36
Dipole, Da:	4.01
IP(EA), eV:	-8.68(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-cyclopropyl-2-(oxan-2-ylmethyl)-N-propylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=NC(=NC2=C1CCCCC2)CC(C)OC

DOS

IR

Vibrations