Geometry & MOs

Info

ID:

129703

PubChem CID:

51073603

Reduced:

OSN3C17H23 (1)

Stoich.:

ABC3D17E23 (1)

Weight, g/mol:

249.068431

ΔHf, kcal/mol:

15.29

Dipole, Da:

2.38

IP(EA), eV:

-8.28(-0.38)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-cyclopropyl-2-(5-thiophen-3-yltetrazol-2-yl)acetamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC)CN2CCN(CC2)CC3=CSC=N3

DOS

IR

Vibrations