Geometry & MOs

Info

ID:	342987
PubChem CID:	127266150
Reduced:	NOC9H11 (2)
Stoich.:	ABC9D11 (2)
Weight, g/mol:	333.082407
ΔH_f, kcal/mol:	-68.66
Dipole, Da:	5.95
IP(EA), eV:	-8.74(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-[[[3-hydroxy-2-(trifluoromethoxy)benzoyl]amino]methyl]cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CC1(CCCCC1)NC(=O)C2=CC(=O)C3=CC=CC=C3N2C

DOS

IR

Vibrations