Geometry & MOs

Info

ID:	292172
PubChem CID:	114467685
Reduced:	NOC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	285.16079
ΔH_f, kcal/mol:	-60.19
Dipole, Da:	5.22
IP(EA), eV:	-9.02(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-chloro-2,5-diethylpyrazol-3-yl)methyl]-2-(2-methylprop-2-enoxy)ethanamine

Drug info:

PubChemData

Smile

CC(=C)COCCNCC(=O)N(C)C1CC1

DOS

IR

Vibrations