Geometry & MOs

Info

ID:	351414
PubChem CID:	127280302
Reduced:	O3N6C17H26 (1)
Stoich.:	A3B6C17D26 (1)
Weight, g/mol:	398.198777
ΔH_f, kcal/mol:	-103.91
Dipole, Da:	4.11
IP(EA), eV:	-9.02(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-methyl-N-(2-pyrrolidin-1-ylethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCC(=O)N(C)CCN3CCCC3

DOS

IR

Vibrations