Geometry & MOs

Info

ID:	15883
PubChem CID:	454384
Reduced:	N2O5C28H40 (1)
Stoich.:	A2B5C28D40 (1)
Weight, g/mol:	484.293722
ΔH_f, kcal/mol:	-250.29
Dipole, Da:	5.88
IP(EA), eV:	-9.38(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(2S,3S,5S)-3-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]-1,6-diphenylhexan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C[C@@H]([C@H](CC2=CC=CC=C2)NC(=O)OC(C)(C)C)O

DOS

IR

Vibrations