Geometry & MOs

Info

ID:	379217
PubChem CID:	134356804
Reduced:	FO4N7C19H26 (1)
Stoich.:	AB4C7D19E26 (1)
Weight, g/mol:	435.203031
ΔH_f, kcal/mol:	-129.86
Dipole, Da:	5.01
IP(EA), eV:	-9.98(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(5S)-5-[(6-fluoropyridine-3-carbonyl)amino]-6-oxo-7-(tetrazol-1-yl)heptyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCC[C@@H](C(=O)CN1N=CN=N1)NC(=O)C2=CN=C(C=C2)F

DOS

IR

Vibrations