Geometry & MOs

Info

ID:	197653
PubChem CID:	78984071
Reduced:	OSBr2N2C14H14 (1)
Stoich.:	ABC2D2E14F14 (1)
Weight, g/mol:	329.01637
ΔH_f, kcal/mol:	16.53
Dipole, Da:	4.38
IP(EA), eV:	-8.75(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-bromophenyl)methoxy]quinazolin-6-amine

Drug info:

PubChemData

Smile

CCN(CC1=CC(=CC=C1)N)C(=O)C2=CC(=C(S2)Br)Br

DOS

IR

Vibrations