Geometry & MOs

Info

ID:	270761
PubChem CID:	103638000
Reduced:	O2N3C16H21 (1)
Stoich.:	A2B3C16D21 (1)
Weight, g/mol:	316.0245
ΔH_f, kcal/mol:	-47.34
Dipole, Da:	1.67
IP(EA), eV:	-8.83(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[2-[cyclopropyl(ethyl)amino]ethyl]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CCNC(=O)C1=CC2=C(C=C1)NC(=O)C2)C3CC3

DOS

IR

Vibrations