Geometry & MOs

Info

ID:	204741
PubChem CID:	80002586
Reduced:	N3O5C13H17 (1)
Stoich.:	A3B5C13D17 (1)
Weight, g/mol:	302.124212
ΔH_f, kcal/mol:	-187.88
Dipole, Da:	2.69
IP(EA), eV:	-9.95(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(aminomethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)NCC2=CC=C(O2)C(=O)O)C(=O)N

DOS

IR

Vibrations