Geometry & MOs

Info

ID:	210198
PubChem CID:	80773858
Reduced:	N2C7H12 (2)
Stoich.:	A2B7C12 (2)
Weight, g/mol:	290.247047
ΔH_f, kcal/mol:	10.48
Dipole, Da:	3.37
IP(EA), eV:	-8.66(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cycloheptyl-6-N-ethyl-4-N-methyl-5-propan-2-ylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCCNC1=C(C(=NC=N1)N(C)C2CCCC2)C

DOS

IR

Vibrations