Geometry & MOs

Info

ID:	326734
PubChem CID:	126688107
Reduced:	NO2C16H27 (1)
Stoich.:	AB2C16D27 (1)
Weight, g/mol:	269.9654
ΔH_f, kcal/mol:	-117.65
Dipole, Da:	4.22
IP(EA), eV:	-8.15(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-iodo-7-methylquinazoline

Drug info:

PubChemData

Smile

COC1C(C(NC2=C1CCCC2)C3CCCCC3)O

DOS

IR

Vibrations