Geometry & MOs

Info

ID:

273906

PubChem CID:

103805769

Reduced:

ON2C18H30 (1)

Stoich.:

AB2C18D30 (1)

Weight, g/mol:

292.176248

ΔHf, kcal/mol:

-102.38

Dipole, Da:

3.45

IP(EA), eV:

-9.31(1.11)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

N-[(1R,2R)-2-aminocyclohexyl]-3-(trifluoromethyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC[C@H]([C@@H](C1)N)NC(=O)CC23CC4CC(C2)CC(C4)C3

DOS

IR

Vibrations