Geometry & MOs

Info

ID:	186142
PubChem CID:	77396022
Reduced:	SN4O6C34H38 (1)
Stoich.:	AB4C6D34E38 (1)
Weight, g/mol:	316.139862
ΔH_f, kcal/mol:	-178.9
Dipole, Da:	12.16
IP(EA), eV:	-8.1(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1,1-trifluoropropan-2-yl N-(1-benzylpyrrolidin-3-yl)carbamate

Drug info:

PubChemData

Smile

CC1CN(C(=O)C2=C(C(=CC=C2)NC(=O)NC3=CC=CC4=CC=CC=C43)OC1CN(C)S(=O)(=O)C5=CC=CC(=C5)C)C(C)CO

DOS

IR

Vibrations