Geometry & MOs

Info

ID:	127070
PubChem CID:	50989621
Reduced:	NOC7H9 (2)
Stoich.:	ABC7D9 (2)
Weight, g/mol:	289.092578
ΔH_f, kcal/mol:	-37.25
Dipole, Da:	2.61
IP(EA), eV:	-8.88(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-amino-3-phenylmethoxy-3-(trifluoromethyl)cyclobutane-1-carboxylic acid

Drug info:

PubChemData

Smile

C1C2CN(CC1C2(C(=O)O)N)CC3=CC=CC=C3

DOS

IR

Vibrations