Geometry & MOs

Info

ID:	207723
PubChem CID:	80443424
Reduced:	ON2C12H26 (1)
Stoich.:	AB2C12D26 (1)
Weight, g/mol:	254.196983
ΔH_f, kcal/mol:	-72.96
Dipole, Da:	2.51
IP(EA), eV:	-8.69(2.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-ethyl-3-methyl-1-N-propyl-1-N-(2,2,2-trifluoroethyl)butane-1,2-diamine

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC(C(C)C)NC

DOS

IR

Vibrations