Geometry & MOs

Info

ID:	74761
PubChem CID:	48422422
Reduced:	ClN3O4C19H20 (1)
Stoich.:	AB3C4D19E20 (1)
Weight, g/mol:	247.157229
ΔH_f, kcal/mol:	-119.76
Dipole, Da:	2.41
IP(EA), eV:	-9.5(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(cyclopropylmethoxy)-N-(2,3-dimethylphenyl)propanamide

Drug info:

PubChemData

Smile

COC(=O)NC(CC1=CC=CC=C1)C(=O)NNC(=O)CC2=CC=C(C=C2)Cl

DOS

IR

Vibrations