Geometry & MOs

Info

ID:	288370
PubChem CID:	104315804
Reduced:	Br2N4C15H16 (1)
Stoich.:	A2B4C15D16 (1)
Weight, g/mol:	346.07931
ΔH_f, kcal/mol:	65.61
Dipole, Da:	4.74
IP(EA), eV:	-8.96(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-bromopyridin-2-yl)-4-methyl-5,6,7,8-tetrahydroquinazolin-6-yl]-N-methylmethanamine

Drug info:

PubChemData

Smile

CNCC1CCC2=NC(=NC=C2C1)C3=C(C=C(C=N3)Br)Br

DOS

IR

Vibrations