Geometry & MOs

Info

ID:	138006
PubChem CID:	52299174
Reduced:	NOC10H15 (2)
Stoich.:	ABC10D15 (2)
Weight, g/mol:	331.238553
ΔH_f, kcal/mol:	-62.55
Dipole, Da:	2.59
IP(EA), eV:	-9.03(0.4)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(1R,3S)-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ium-1-ylethyl]-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC(=C[C@@H]1[C@H](C1(C)C)C(=O)NC[C@@H](C2=CC=CO2)N3CCCC3)C

DOS

IR

Vibrations