Geometry & MOs

Info

ID:	296486
PubChem CID:	117578208
Reduced:	N5C11H19 (1)
Stoich.:	A5B11C19 (1)
Weight, g/mol:	266.174276
ΔH_f, kcal/mol:	19.14
Dipole, Da:	1.76
IP(EA), eV:	-8.93(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[6-(tert-butylamino)-2-methylpyrimidin-4-yl]amino]butanoic acid

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)NCC2CCNC2)NC

DOS

IR

Vibrations