Geometry & MOs

Info

ID:	175688
PubChem CID:	75937433
Reduced:	O3N4C20H28 (1)
Stoich.:	A3B4C20D28 (1)
Weight, g/mol:	386.231791
ΔH_f, kcal/mol:	-82.31
Dipole, Da:	5.48
IP(EA), eV:	-8.72(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,4-dimethoxyphenyl)-N-[1-(1,3,5-trimethylpyrazol-4-yl)ethyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CC1COC2=CC=CC=C2O1)C(=O)NC(C)C3=C(N(N=C3C)C)C

DOS

IR

Vibrations