Geometry & MOs

Info

ID:	193327
PubChem CID:	78376301
Reduced:	N2O2H12C15 (1)
Stoich.:	A2B2C12D15 (1)
Weight, g/mol:	305.98647
ΔH_f, kcal/mol:	19.0
Dipole, Da:	4.56
IP(EA), eV:	-9.11(-2.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-(4-azidophenyl)-5-bromo-5H-pyrimidin-4-one

Drug info:

PubChemData

Smile

C1=CC2=NC(C(=O)N=C2C=C1)CC3=CC(=CC=C3)O

DOS

IR

Vibrations