Geometry & MOs

Info

ID:	31855
PubChem CID:	3721220
Reduced:	ON2C7H8 (3)
Stoich.:	AB2C7D8 (3)
Weight, g/mol:	436.185903
ΔH_f, kcal/mol:	8.66
Dipole, Da:	7.01
IP(EA), eV:	-8.62(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[5-[4-(morpholin-4-ylmethyl)phenyl]tetrazol-2-yl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)NC(=O)CN2N=C(N=N2)C3=CC=C(C=C3)CN4CCOCC4

DOS

IR

Vibrations