Geometry & MOs

Info

ID:	175521
PubChem CID:	75916391
Reduced:	N3O4C25H29 (1)
Stoich.:	A3B4C25D29 (1)
Weight, g/mol:	459.182792
ΔH_f, kcal/mol:	-133.02
Dipole, Da:	4.91
IP(EA), eV:	-8.79(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl N-[3-[[1-(benzenesulfonyl)piperidine-2-carbonyl]amino]phenyl]carbamate

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C3(CCC2)C(=O)N(C(=O)N3)CC(CN4CCC5=CC=CC=C5C4)O

DOS

IR

Vibrations