Geometry & MOs

Info

ID:	243530
PubChem CID:	99226407
Reduced:	FO2N4C22H33 (1)
Stoich.:	AB2C4D22E33 (1)
Weight, g/mol:	387.158292
ΔH_f, kcal/mol:	-123.8
Dipole, Da:	7.37
IP(EA), eV:	-8.51(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(S)-(1-methylimidazol-2-yl)-phenylmethyl]-2-(7-methyl-2-oxochromen-4-yl)acetamide

Drug info:

PubChemData

Smile

C[C@H]1C[C@@H](CN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC(=C(C=C3)N(C)C)F)C

DOS

IR

Vibrations