Geometry & MOs

Info

ID:	189767
PubChem CID:	77902104
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	349.21139
ΔH_f, kcal/mol:	13.58
Dipole, Da:	1.44
IP(EA), eV:	-8.69(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(methoxymethyl)pyrazolidin-3-yl]methyl]-3-(3-methoxyphenyl)pyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

COCCN1CC2CCC1CN(C2)C3=NOC(=N3)C4=CC=CC=C4

DOS

IR

Vibrations