Geometry & MOs

Info

ID:	210007
PubChem CID:	80749983
Reduced:	N2O5C10H18 (1)
Stoich.:	A2B5C10D18 (1)
Weight, g/mol:	284.200097
ΔH_f, kcal/mol:	-230.97
Dipole, Da:	2.16
IP(EA), eV:	-9.3(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-cyclohexyl-2-N-propylquinazoline-2,4-diamine

Drug info:

PubChemData

Smile

C1CNCCC1OCC(=O)N[C@H](CO)C(=O)O

DOS

IR

Vibrations