Geometry & MOs

Info

ID:	225650
PubChem CID:	87219153
Reduced:	FSN4O6C35H45 (1)
Stoich.:	ABC4D6E35F45 (1)
Weight, g/mol:	101.047678
ΔH_f, kcal/mol:	-257.89
Dipole, Da:	6.21
IP(EA), eV:	-8.67(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(oxiran-2-ylmethyl)formamide

Drug info:

PubChemData

Smile

CCC1=C(N(C(=N1)OCC)CC2=C(C=C(C=C2)C3=CC=CC=C3C(=O)O)F)CNC(=O)[C@H](CC(C)C)SC(=O)CCN4CCOCC4

DOS

IR

Vibrations