Geometry & MOs

Info

ID:	363441
PubChem CID:	127311244
Reduced:	N2O3C21H28 (1)
Stoich.:	A2B3C21D28 (1)
Weight, g/mol:	336.241293
ΔH_f, kcal/mol:	-138.94
Dipole, Da:	3.55
IP(EA), eV:	-8.1(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(oxolan-2-yl)propan-2-yl]-2-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C(C1)C(=O)NC2=CC3=C(C=C2)OCCC3)C(=O)N4CCCC4

DOS

IR

Vibrations