Geometry & MOs

Info

ID:	271689
PubChem CID:	103688492
Reduced:	ON2C16H22 (1)
Stoich.:	AB2C16D22 (1)
Weight, g/mol:	218.08777
ΔH_f, kcal/mol:	-6.35
Dipole, Da:	3.43
IP(EA), eV:	-8.46(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-pent-4-enyl-1,3-benzothiazol-6-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(C)C)OCCC2=CN(N=C2)C

DOS

IR

Vibrations