Geometry & MOs

Info

ID:	74454
PubChem CID:	48421899
Reduced:	N2S2O3C18H22 (1)
Stoich.:	A2B2C3D18E22 (1)
Weight, g/mol:	287.152144
ΔH_f, kcal/mol:	-88.68
Dipole, Da:	2.57
IP(EA), eV:	-8.93(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(1-benzofuran-2-yl)ethyl]-2-(cyclopropylmethoxy)propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCCSCC2=CC=CS2

DOS

IR

Vibrations