Geometry & MOs

Info

ID:	249744
PubChem CID:	103091763
Reduced:	SN3C12H17 (1)
Stoich.:	AB3C12D17 (1)
Weight, g/mol:	203.131014
ΔH_f, kcal/mol:	39.47
Dipole, Da:	5.85
IP(EA), eV:	-8.27(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-(2,3-dihydro-1-benzofuran-5-yl)-3-methylbut-3-en-2-amine

Drug info:

PubChemData

Smile

CC1=CSC2=NC(=C(N12)/C=C(\C)/C(C)N)C

DOS

IR

Vibrations