Geometry & MOs

Info

ID:	210236
PubChem CID:	80778726
Reduced:	ON5C15H25 (1)
Stoich.:	AB5C15D25 (1)
Weight, g/mol:	290.247047
ΔH_f, kcal/mol:	-25.23
Dipole, Da:	6.34
IP(EA), eV:	-8.82(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(cyclohexylmethyl)-5-ethyl-4-N-methyl-6-N-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCC1=C(N=CN=C1N(C)CC(=O)N2CCCC2)NCC

DOS

IR

Vibrations