Geometry & MOs

Info

ID:	367422
PubChem CID:	127324584
Reduced:	ON4C14H22 (1)
Stoich.:	AB4C14D22 (1)
Weight, g/mol:	374.243024
ΔH_f, kcal/mol:	-11.19
Dipole, Da:	2.82
IP(EA), eV:	-9.12(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-4-(4-ethoxy-6-methylpyrimidin-2-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)N3CCC(CC3)C#N

DOS

IR

Vibrations