Geometry & MOs

Info

ID:	294530
PubChem CID:	117467670
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	289.179027
ΔH_f, kcal/mol:	-72.26
Dipole, Da:	5.03
IP(EA), eV:	-8.55(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-tert-butyl-2,5-dimethoxyphenyl)-2-methylpyrazol-3-amine

Drug info:

PubChemData

Smile

CC1(C(=O)NC2=C(O1)C=CC(=C2)C3CC(CN3C)CN)C

DOS

IR

Vibrations