Geometry & MOs

Info

ID:	299369
PubChem CID:	117682744
Reduced:	OF2N5H21C26 (1)
Stoich.:	AB2C5D21E26 (1)
Weight, g/mol:	173.057645
ΔH_f, kcal/mol:	9.51
Dipole, Da:	2.43
IP(EA), eV:	-9.22(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-chloro-4-methoxyphenyl)-dideuteriomethanamine

Drug info:

PubChemData

Smile

CN1C=CC(=C1)C(=O)N2CCC3=C(C2)C(=NN3CC4=C(C=C(C=C4)F)F)C5=CC=CC(=C5)C#N

DOS

IR

Vibrations