Geometry & MOs

Info

ID:	346072
PubChem CID:	127270560
Reduced:	SO3N6C17H28 (1)
Stoich.:	AB3C6D17E28 (1)
Weight, g/mol:	336.216141
ΔH_f, kcal/mol:	-100.31
Dipole, Da:	7.2
IP(EA), eV:	-9.02(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2,2-dimethylmorpholin-4-yl)ethyl]-2-(3-methyl-1,2-oxazol-5-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1(CN(CCO1)CCNC(=O)N2CCC(CC2)C(=O)NC3=NN=CS3)C

DOS

IR

Vibrations