Geometry & MOs

Info

ID:	213201
PubChem CID:	81063152
Reduced:	NO4C15H21 (1)
Stoich.:	AB4C15D21 (1)
Weight, g/mol:	287.096914
ΔH_f, kcal/mol:	-177.61
Dipole, Da:	3.38
IP(EA), eV:	-9.03(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(difluoromethoxy)benzoyl]amino]-3-methylbutanoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)OCC(=O)NCC(C)CC(=O)O)C

DOS

IR

Vibrations