Geometry & MOs

Info

ID:	406238
PubChem CID:	135076987
Reduced:	N5O5C19H35 (1)
Stoich.:	A5B5C19D35 (1)
Weight, g/mol:	521.263819
ΔH_f, kcal/mol:	-219.75
Dipole, Da:	7.16
IP(EA), eV:	-9.81(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-[[3-azido-4-phenyl-2-(2-phenylacetyl)oxybutanoyl]amino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)OC(C(CC(C)C)N=[N+]=[N-])C(=O)NC(C)(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations