Geometry & MOs

Info

ID:	210199
PubChem CID:	80773859
Reduced:	N4C17H30 (1)
Stoich.:	A4B17C30 (1)
Weight, g/mol:	290.247047
ΔH_f, kcal/mol:	-3.82
Dipole, Da:	2.95
IP(EA), eV:	-8.67(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cycloheptyl-5-ethyl-4-N-methyl-6-N-propylpyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CCNC1=C(C(=NC=N1)N(C)C2CCCCCC2)C(C)C

DOS

IR

Vibrations