Geometry & MOs

Info

ID:	276245
PubChem CID:	103821651
Reduced:	O2N3C17H35 (1)
Stoich.:	A2B3C17D35 (1)
Weight, g/mol:	352.11654
ΔH_f, kcal/mol:	-145.51
Dipole, Da:	1.19
IP(EA), eV:	-8.58(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[2-chloro-6-(trifluoromethyl)anilino]propyl]carbamate

Drug info:

PubChemData

Smile

CC1CCN(CC1)CCCNCCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations