Geometry & MOs

Info

ID:	75330
PubChem CID:	48423336
Reduced:	SN2O3C17H20 (1)
Stoich.:	AB2C3D17E20 (1)
Weight, g/mol:	253.11365
ΔH_f, kcal/mol:	-96.67
Dipole, Da:	1.31
IP(EA), eV:	-9.0(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[(3-methylthiophen-2-yl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(SC=C1)CNC(=O)C(CC2=CC=CC=C2)NC(=O)OC

DOS

IR

Vibrations