Geometry & MOs

Info

ID:	182403
PubChem CID:	76885528
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	358.236876
ΔH_f, kcal/mol:	-54.6
Dipole, Da:	4.48
IP(EA), eV:	-7.97(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-N-[[3-(2,3-dihydro-1,4-benzodioxin-6-yl)pyrazolidin-4-yl]methyl]methanamine

Drug info:

PubChemData

Smile

CC1CCC(C(=O)N1)C(=O)NC2=CC=C(C=C2)NC3=CC=CC=C3

DOS

IR

Vibrations