Geometry & MOs

Info

ID:	439380
PubChem CID:	135229153
Reduced:	O3N5C18H25 (1)
Stoich.:	A3B5C18D25 (1)
Weight, g/mol:	529.315186
ΔH_f, kcal/mol:	-77.26
Dipole, Da:	3.82
IP(EA), eV:	-9.01(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[6-(2-methyl-4-oxo-3-phenylmethoxypyridin-1-yl)-1-[(2-methylpropan-2-yl)oxycarbonylamino]hexan-2-yl]carbamate

Drug info:

PubChemData

Smile

CCCCC(CO)NC1=NC(=NC=C1OCC2=NC(=CC=C2)C(=O)N)C

DOS

IR

Vibrations