Geometry & MOs

Info

ID:	364568
PubChem CID:	127315820
Reduced:	ON4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	276.195011
ΔH_f, kcal/mol:	-35.52
Dipole, Da:	5.0
IP(EA), eV:	-8.76(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-methyloxolan-3-yl)methyl]-6-piperidin-1-ylpyrimidin-4-amine

Drug info:

PubChemData

Smile

CC1CCCN(C1)C2=NC=NC(=C2)NCC3(CCOC3)C

DOS

IR

Vibrations