Geometry & MOs

Info

ID:	352150
PubChem CID:	127283218
Reduced:	O2N3C18H21 (1)
Stoich.:	A2B3C18D21 (1)
Weight, g/mol:	245.141579
ΔH_f, kcal/mol:	-27.98
Dipole, Da:	4.25
IP(EA), eV:	-8.96(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-inden-1-yl(1,4-oxazepan-4-yl)methanone

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2C1C(=O)NC3=CC=NN3CC4CCOC4

DOS

IR

Vibrations