Geometry & MOs

Info

ID:	368250
PubChem CID:	127327802
Reduced:	ON6C21H36 (1)
Stoich.:	AB6C21D36 (1)
Weight, g/mol:	347.268511
ΔH_f, kcal/mol:	-41.49
Dipole, Da:	5.25
IP(EA), eV:	-8.63(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(dimethylamino)cycloheptyl]methyl]-3-(1-methylpyrazol-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=C(C=C1)N(C)C2CCN(CC2)C(=O)NC3CC(NC(C3)(C)C)(C)C

DOS

IR

Vibrations