Geometry & MOs

Info

ID:	28587
PubChem CID:	828470
Reduced:	NO4C18H23 (1)
Stoich.:	AB4C18D23 (1)
Weight, g/mol:	340.121178
ΔH_f, kcal/mol:	-153.79
Dipole, Da:	2.67
IP(EA), eV:	-9.18(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R)-2-cyano-1-phenyl-1H-benzo[f]chromen-3-yl]acetamide

Drug info:

PubChemData

Smile

CCCN(CCC)C(=O)COC1=CC2=C(C=C1)C(=CC(=O)O2)C

DOS

IR

Vibrations