Geometry & MOs

Info

ID:	212919
PubChem CID:	81062244
Reduced:	N3O3C8H17 (1)
Stoich.:	A3B3C8D17 (1)
Weight, g/mol:	303.09462
ΔH_f, kcal/mol:	-116.3
Dipole, Da:	4.14
IP(EA), eV:	-9.67(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-2-ethyl-5-methylpyrazol-3-yl)methyl]-2-ethoxy-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C)OCCN(C)C(=O)C(=O)NN

DOS

IR

Vibrations