Geometry & MOs

Info

ID:	440284
PubChem CID:	135230231
Reduced:	N3C15H23 (1)
Stoich.:	A3B15C23 (1)
Weight, g/mol:	331.073295
ΔH_f, kcal/mol:	40.15
Dipole, Da:	0.21
IP(EA), eV:	-9.09(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-1-amino-1-chloro-3-iminoprop-1-en-2-yl]-N-ethyl-3-(3,3,3-trifluoropropylsulfanyl)propanamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=CC=C1NC(C)(C)/N=C\C=N

DOS

IR

Vibrations