Geometry & MOs

Info

ID:	267336
PubChem CID:	103581877
Reduced:	N2O3C16H32 (1)
Stoich.:	A2B3C16D32 (1)
Weight, g/mol:	337.07897
ΔH_f, kcal/mol:	-185.14
Dipole, Da:	1.54
IP(EA), eV:	-8.7(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-N-[(5-methoxy-1,3-dimethylpyrazol-4-yl)methyl]-3,5-dimethylaniline

Drug info:

PubChemData

Smile

CC(COC)NC1CCCCCC1NC(=O)OC(C)(C)C

DOS

IR

Vibrations