Geometry & MOs

Info

ID:	84365
PubChem CID:	49866039
Reduced:	ClON2C17H25 (1)
Stoich.:	ABC2D17E25 (1)
Weight, g/mol:	383.220892
ΔH_f, kcal/mol:	-57.29
Dipole, Da:	2.96
IP(EA), eV:	-8.89(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-diethyl-4-[5-(3,4,5-trimethoxyphenyl)-4,5-dihydro-1H-pyrazol-3-yl]aniline

Drug info:

PubChemData

Smile

CC(C)(C)CCC1(CCNC1)C(=O)C2=CC(=C(C=C2)N)Cl

DOS

IR

Vibrations