Geometry & MOs

Info

ID:	270251
PubChem CID:	103635624
Reduced:	SN4C13H16 (1)
Stoich.:	AB4C13D16 (1)
Weight, g/mol:	171.061946
ΔH_f, kcal/mol:	64.57
Dipole, Da:	2.08
IP(EA), eV:	-8.77(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,3,3-trifluoro-2-hydroxypropyl)guanidine

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCN=C(N)NC2=CC=CC=C2

DOS

IR

Vibrations