Geometry & MOs

Info

ID:	372759
PubChem CID:	131304117
Reduced:	NF2C10H13 (1)
Stoich.:	AB2C10D13 (1)
Weight, g/mol:	211.114319
ΔH_f, kcal/mol:	-90.02
Dipole, Da:	3.13
IP(EA), eV:	-9.31(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(cyclohexylmethyl)-1,2,4-thiadiazol-3-yl]methanamine

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)[C@H](CCF)N)F

DOS

IR

Vibrations