Geometry & MOs

Info

ID:	39561
PubChem CID:	8141344
Reduced:	O2S2N3H11C16 (1)
Stoich.:	A2B2C3D11E16 (1)
Weight, g/mol:	391.099063
ΔH_f, kcal/mol:	32.25
Dipole, Da:	2.49
IP(EA), eV:	-8.37(-1.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[[4-(5-methylfuran-2-yl)-1,3-thiazol-2-yl]amino]-2-oxoethyl]naphthalene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(O1)C2=CSC(=N2)NC(=O)C3=CC4=C(C=C3)N=CS4

DOS

IR

Vibrations