Geometry & MOs

Info

ID:	132362
PubChem CID:	51348863
Reduced:	NO3C18H37 (1)
Stoich.:	AB3C18D37 (1)
Weight, g/mol:	353.199094
ΔH_f, kcal/mol:	-214.58
Dipole, Da:	4.74
IP(EA), eV:	-9.83(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-ethyl-1-[4-[(2-methylphenyl)methoxy]phenyl]pyrrolidin-2-yl]acetic acid

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(C(CO)NC(=O)C)O

DOS

IR

Vibrations