Geometry & MOs

Info

ID:	350847
PubChem CID:	127279135
Reduced:	O2N3C18H23 (1)
Stoich.:	A2B3C18D23 (1)
Weight, g/mol:	330.194343
ΔH_f, kcal/mol:	3.71
Dipole, Da:	2.14
IP(EA), eV:	-8.94(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-cyclobutylpyrrolidin-1-yl)-N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=NOC(=N2)CN3CCCC3C4CCC4

DOS

IR

Vibrations