Geometry & MOs

Info

ID:	271716
PubChem CID:	103689501
Reduced:	NO3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	271.093247
ΔH_f, kcal/mol:	-112.11
Dipole, Da:	2.11
IP(EA), eV:	-9.48(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-imidazol-2-ylmethyl)-1-[3-(trifluoromethoxy)phenyl]methanamine

Drug info:

PubChemData

Smile

CCC(CO)(CO)NCC1=CC=CO1

DOS

IR

Vibrations