Geometry & MOs

Info

ID:	330607
PubChem CID:	127248014
Reduced:	O2N5C13H23 (1)
Stoich.:	A2B5C13D23 (1)
Weight, g/mol:	280.189926
ΔH_f, kcal/mol:	-50.67
Dipole, Da:	3.2
IP(EA), eV:	-8.95(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[(dimethylamino)methyl]-3-hydroxypyrrolidin-1-yl]-(1-propylpyrazol-3-yl)methanone

Drug info:

PubChemData

Smile

CC(C)(C(=O)N1CCC(C1)(CN(C)C)O)N2C=NC=N2

DOS

IR

Vibrations