Geometry & MOs

Info

ID:	265043
PubChem CID:	103507705
Reduced:	SO2N3C13H21 (1)
Stoich.:	AB2C3D13E21 (1)
Weight, g/mol:	367.99943
ΔH_f, kcal/mol:	-89.4
Dipole, Da:	3.91
IP(EA), eV:	-8.11(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-amino-5-[(5-bromo-2-fluorophenyl)methylamino]thiophen-2-yl]-cyclopropylmethanone

Drug info:

PubChemData

Smile

CCNC(=O)C1=C(C=C(S1)N2C[C@H](O[C@H](C2)C)C)N

DOS

IR

Vibrations