Geometry & MOs

Info

ID:	182678
PubChem CID:	76922733
Reduced:	BrON2H15C16 (1)
Stoich.:	ABC2D15E16 (1)
Weight, g/mol:	315.02185
ΔH_f, kcal/mol:	10.2
Dipole, Da:	9.34
IP(EA), eV:	-8.29(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-3-hydroxyiminopropyl)-4-bromo-2-hydroxy-N-methylbenzamide

Drug info:

PubChemData

Smile

CCN1C2=C(C=C(C=C2)C)NC1=C3C=CC(=CC3=O)Br

DOS

IR

Vibrations