Geometry & MOs

Info

ID:	20773
PubChem CID:	585620
Reduced:	NO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	269.105193
ΔH_f, kcal/mol:	-61.24
Dipole, Da:	5.33
IP(EA), eV:	-8.28(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-amino-2-hydroxyphenyl)-3-(4-methoxyphenyl)prop-2-en-1-one

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=CC(=O)C2=C(C=CC(=C2)N)O

DOS

IR

Vibrations