Geometry & MOs

Info

ID:	210924
PubChem CID:	80871282
Reduced:	ON5C15H27 (1)
Stoich.:	AB5C15D27 (1)
Weight, g/mol:	232.132411
ΔH_f, kcal/mol:	-33.6
Dipole, Da:	2.74
IP(EA), eV:	-9.02(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-(dimethylamino)ethoxy]quinazolin-2-amine

Drug info:

PubChemData

Smile

CCC1CCCC(C1)OC2=NC(=NC(=N2)N(C)C)NCC

DOS

IR

Vibrations