Geometry & MOs

Info

ID:	155665
PubChem CID:	56366759
Reduced:	SN3O4C20H27 (1)
Stoich.:	AB3C4D20E27 (1)
Weight, g/mol:	389.231456
ΔH_f, kcal/mol:	-135.78
Dipole, Da:	5.87
IP(EA), eV:	-9.3(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[3-(butanoylamino)piperidine-1-carbonyl]phenyl]carbamate

Drug info:

PubChemData

Smile

C1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)CNC(=O)C3CC(=O)N(C3)C4CC4

DOS

IR

Vibrations