Geometry & MOs

Info

ID:	289249
PubChem CID:	104341677
Reduced:	O2N5C13H21 (1)
Stoich.:	A2B5C13D21 (1)
Weight, g/mol:	236.163711
ΔH_f, kcal/mol:	-61.87
Dipole, Da:	5.8
IP(EA), eV:	-9.07(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,2-dimethylpyrrolidin-1-yl)-2-(methoxymethyl)pyrimidin-4-amine

Drug info:

PubChemData

Smile

CCNC1=CC(=NC(=N1)COC)N2CCC(=O)NCC2

DOS

IR

Vibrations