Geometry & MOs

Info

ID:	367030
PubChem CID:	127322962
Reduced:	O2N3C23H29 (1)
Stoich.:	A2B3C23D29 (1)
Weight, g/mol:	372.204907
ΔH_f, kcal/mol:	-66.71
Dipole, Da:	8.08
IP(EA), eV:	-9.24(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-acetyl-N-(1,3-benzodioxol-5-ylmethyl)-N-cyclohexylpyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2C(=C1)CN(C3CCCC3)C(=O)C4CCCN4C(=O)C

DOS

IR

Vibrations