Geometry & MOs

Info

ID:	342126
PubChem CID:	127264839
Reduced:	N2O3C20H22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	328.158706
ΔH_f, kcal/mol:	-64.6
Dipole, Da:	2.08
IP(EA), eV:	-9.25(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-[(dimethylamino)methyl]-3-fluorophenyl]methyl]-3-(3-hydroxyphenyl)prop-2-enamide

Drug info:

PubChemData

Smile

C1CC(OC1)CN(CC2=CN=CC=C2)C(=O)C=CC3=CC(=CC=C3)O

DOS

IR

Vibrations