Geometry & MOs

Info

ID:	312177
PubChem CID:	126603463
Reduced:	SN4C16H28 (1)
Stoich.:	AB4C16D28 (1)
Weight, g/mol:	276.231397
ΔH_f, kcal/mol:	3.25
Dipole, Da:	2.71
IP(EA), eV:	-8.64(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-tert-butylpyrimidin-2-yl)-N-propan-2-ylpiperidin-4-amine

Drug info:

PubChemData

Smile

CC(NC1CCN(CC1)C2=NC=C(C=N2)C(C)(C)C)SC

DOS

IR

Vibrations