Geometry & MOs

Info

ID:	206172
PubChem CID:	80217972
Reduced:	SO2N4C14H24 (1)
Stoich.:	AB2C4D14E24 (1)
Weight, g/mol:	291.231063
ΔH_f, kcal/mol:	-64.51
Dipole, Da:	9.29
IP(EA), eV:	-9.21(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-[(4,4-dimethylcyclohexyl)-methylamino]-2-propan-2-ylpyrimidin-4-yl]methanol

Drug info:

PubChemData

Smile

CC1(CCC(CC1)N(C)C2=NN=C(N2C)SCC(=O)O)C

DOS

IR

Vibrations