Geometry & MOs

Info

ID:	296490
PubChem CID:	117578355
Reduced:	O2N4C13H20 (1)
Stoich.:	A2B4C13D20 (1)
Weight, g/mol:	236.127326
ΔH_f, kcal/mol:	-68.54
Dipole, Da:	7.77
IP(EA), eV:	-9.18(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]cyclopropane-1-carboxylic acid

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)NC(C)(C)CC(=O)O)NC2CC2

DOS

IR

Vibrations