Geometry & MOs

Info

ID:	60905
PubChem CID:	26703023
Reduced:	SF2N3O5H21C23 (1)
Stoich.:	AB2C3D5E21F23 (1)
Weight, g/mol:	372.089226
ΔH_f, kcal/mol:	-237.28
Dipole, Da:	6.76
IP(EA), eV:	-8.67(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[2-[(2-methyl-1,3-benzoxazol-5-yl)amino]-2-oxoethyl]amino]-2-oxoethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=C(C=CC(=C2)NC(=O)CNC(=O)CNC(=O)C3=CC=CS3)OC(F)F

DOS

IR

Vibrations