Geometry & MOs

Info

ID:	276986
PubChem CID:	103826138
Reduced:	ON2C13H24 (1)
Stoich.:	AB2C13D24 (1)
Weight, g/mol:	227.14339
ΔH_f, kcal/mol:	-67.86
Dipole, Da:	3.25
IP(EA), eV:	-9.37(1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(5-fluoropyrimidin-2-yl)amino]-4,4-dimethylpentan-2-ol

Drug info:

PubChemData

Smile

CCC1(CCNC1)C(=O)NCC2(CCC2)C

DOS

IR

Vibrations