Geometry & MOs

Info

ID:	208045
PubChem CID:	80485247
Reduced:	ClSO2N3C14H16 (1)
Stoich.:	ABC2D3E14F16 (1)
Weight, g/mol:	203.131014
ΔH_f, kcal/mol:	-43.62
Dipole, Da:	7.65
IP(EA), eV:	-9.02(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(cyclobutylmethyl)-2,3-dihydro-1-benzofuran-5-amine

Drug info:

PubChemData

Smile

CCCSC1=NN(C(=C1C(=O)O)N)CC2=CC=CC=C2Cl

DOS

IR

Vibrations