Geometry & MOs

Info

ID:	145767
PubChem CID:	53590682
Reduced:	N2O5C17H24 (1)
Stoich.:	A2B5C17D24 (1)
Weight, g/mol:	349.21139
ΔH_f, kcal/mol:	-217.53
Dipole, Da:	4.41
IP(EA), eV:	-8.8(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(azepan-1-yl)-2-oxoethyl]-1,2,4-triazol-3-yl]-2-cyclopentyloxyacetamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCC(=O)NCC1=C2C(=CC=C1)OCCO2

DOS

IR

Vibrations