Geometry & MOs

Info

ID:	347282
PubChem CID:	127272076
Reduced:	FOSN4C20H21 (1)
Stoich.:	ABCD4E20F21 (1)
Weight, g/mol:	370.135114
ΔH_f, kcal/mol:	-31.79
Dipole, Da:	5.75
IP(EA), eV:	-8.92(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3,4-dihydro-2H-chromen-6-ylamino)-2-oxoethyl]-4,5,6,7-tetrahydro-1-benzothiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=CC(=CC(=C2N=C1C)C(=O)NCCC3=NC4=C(S3)CCCC4)F

DOS

IR

Vibrations