Geometry & MOs

Info

ID:	14453
PubChem CID:	411950
Reduced:	N2O3C15H22 (1)
Stoich.:	A2B3C15D22 (1)
Weight, g/mol:	278.163043
ΔH_f, kcal/mol:	-107.82
Dipole, Da:	2.61
IP(EA), eV:	-8.88(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(propan-2-ylamino)propyl]-2,3-dihydro-1,4-benzodioxine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)NCCCNC(=O)C1COC2=CC=CC=C2O1

DOS

IR

Vibrations