Geometry & MOs

Info

ID:	367417
PubChem CID:	127324579
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	374.211804
ΔH_f, kcal/mol:	-54.85
Dipole, Da:	1.67
IP(EA), eV:	-9.04(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopropylpyrrolidin-3-yl)-4-[2-(2-fluorophenyl)acetyl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

C1CC1N2CCC(C2)NC(=O)N[C@H]3[C@H](CC4=CC=CC=C34)O

DOS

IR

Vibrations