Geometry & MOs

Info

ID:	347295
PubChem CID:	127272089
Reduced:	ON4C16H26 (1)
Stoich.:	AB4C16D26 (1)
Weight, g/mol:	318.241962
ΔH_f, kcal/mol:	-23.16
Dipole, Da:	3.55
IP(EA), eV:	-8.58(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-1-methylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)C2=CN(N=C2C3CCCCC3)C

DOS

IR

Vibrations