Geometry & MOs

Info

ID:	180004
PubChem CID:	76565570
Reduced:	F3O6N7C36H52 (1)
Stoich.:	A3B6C7D36E52 (1)
Weight, g/mol:	277.123798
ΔH_f, kcal/mol:	-409.36
Dipole, Da:	5.39
IP(EA), eV:	-9.49(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[4-(5,5-difluoro-2-oxopiperidin-1-yl)pyrrolidin-3-yl]carbamate

Drug info:

PubChemData

Smile

CC1(C2C1C(N(C2)C(=O)C(C(C)(C)C)NC(=O)C(C3CCCCC3)NC(=O)C4=NC=CN=C4)C(=O)NC(CCC(F)(F)F)C(C(=O)NCC=C)O)C

DOS

IR

Vibrations