Geometry & MOs

Info

ID:	272314
PubChem CID:	103739560
Reduced:	SN4C12H22 (1)
Stoich.:	AB4C12D22 (1)
Weight, g/mol:	273.145282
ΔH_f, kcal/mol:	42.9
Dipole, Da:	4.83
IP(EA), eV:	-8.94(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-cyclopropyl-N'-ethyl-N-[5-(trifluoromethyl)pyridin-2-yl]ethane-1,2-diamine

Drug info:

PubChemData

Smile

CCN(CCNC1=NC(=NS1)C(C)C)C2CC2

DOS

IR

Vibrations