Geometry & MOs

Info

ID:	74417
PubChem CID:	48421839
Reduced:	SN2O3C16H18 (1)
Stoich.:	AB2C3D16E18 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-85.56
Dipole, Da:	2.62
IP(EA), eV:	-9.16(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-[(2-methylphenyl)methyl]propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NCC2=CC=CS2

DOS

IR

Vibrations