Geometry & MOs

Info

ID:	242563
PubChem CID:	97857364
Reduced:	N4C15H26 (1)
Stoich.:	A4B15C26 (1)
Weight, g/mol:	301.179027
ΔH_f, kcal/mol:	38.27
Dipole, Da:	4.14
IP(EA), eV:	-8.53(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[5-[[(2S,3S)-2-methyloxolan-3-yl]amino]-3-(2-methylphenyl)pyrazol-1-yl]ethanol

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](CN1C2CC2)NC3=CC=NN3CC(C)C

DOS

IR

Vibrations