Geometry & MOs

Info

ID:	379215
PubChem CID:	134356790
Reduced:	NO6C25H43 (1)
Stoich.:	AB6C25D43 (1)
Weight, g/mol:	408.248504
ΔH_f, kcal/mol:	-298.46
Dipole, Da:	2.89
IP(EA), eV:	-8.28(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(5S)-5-(cyclopentanecarbonylamino)-6-oxo-7-(tetrazol-2-yl)heptyl]carbamate

Drug info:

PubChemData

Smile

CC[C@](C)(CN(CCCC(=O)OC)C1=CC(=CC(=C1)CO)CO)OCCC(C)(CC)OC

DOS

IR

Vibrations