Geometry & MOs

Info

ID:	302597
PubChem CID:	124385247
Reduced:	N3C8H15 (1)
Stoich.:	A3B8C15 (1)
Weight, g/mol:	231.98474
ΔH_f, kcal/mol:	8.67
Dipole, Da:	3.92
IP(EA), eV:	-9.07(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(4-bromopyrazol-1-yl)butanoic acid

Drug info:

PubChemData

Smile

CC1=C(C(=NN1)C)C[C@H](C)N

DOS

IR

Vibrations