Geometry & MOs

Info

ID:	259342
PubChem CID:	103164349
Reduced:	ClON2C16H25 (1)
Stoich.:	ABC2D16E25 (1)
Weight, g/mol:	221.152812
ΔH_f, kcal/mol:	-40.06
Dipole, Da:	1.99
IP(EA), eV:	-9.06(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclobutyl-3-(6-methoxypyrimidin-4-yl)propan-2-amine

Drug info:

PubChemData

Smile

CCNC(CC1CC(C1)OCC)CC2=C(C=NC=C2)Cl

DOS

IR

Vibrations