Geometry & MOs

Info

ID:	210753
PubChem CID:	80851796
Reduced:	FN5C13H16 (1)
Stoich.:	AB5C13D16 (1)
Weight, g/mol:	236.163711
ΔH_f, kcal/mol:	-8.88
Dipole, Da:	2.95
IP(EA), eV:	-8.86(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-[2-(cyclopropylmethoxy)ethyl]-4-N,2-dimethylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C)NC2=NC(=NC(=C2)N)N)F

DOS

IR

Vibrations