Geometry & MOs

Info

ID:	198442
PubChem CID:	79101165
Reduced:	N4C13H20 (1)
Stoich.:	A4B13C20 (1)
Weight, g/mol:	310.07931
ΔH_f, kcal/mol:	54.62
Dipole, Da:	6.11
IP(EA), eV:	-8.01(0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-bromo-2-ethyl-5-methylpyrazol-3-yl)methyl]-2,5-dimethylpyrrol-1-amine

Drug info:

PubChemData

Smile

CC1=CC=C(N1NCC2=NN(C=C2)C(C)C)C

DOS

IR

Vibrations