Geometry & MOs

Info

ID:	145604
PubChem CID:	53555033
Reduced:	SO3N4H14C16 (1)
Stoich.:	AB3C4D14E16 (1)
Weight, g/mol:	324.252526
ΔH_f, kcal/mol:	-44.68
Dipole, Da:	1.18
IP(EA), eV:	-8.83(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(cyclohexylcarbamoylamino)propyl]-N,N-dimethylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)NC1=NC2=C(S1)C=C(C=C2)NC(=O)C3=CC=NC=C3

DOS

IR

Vibrations