Geometry & MOs

Info

ID:	61079
PubChem CID:	26705330
Reduced:	SN3O4H15C19 (1)
Stoich.:	AB3C4D15E19 (1)
Weight, g/mol:	431.184506
ΔH_f, kcal/mol:	-100.77
Dipole, Da:	7.96
IP(EA), eV:	-9.04(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[3-[[2-[[(1S)-1-phenylethyl]carbamoyl]phenyl]carbamoyl]phenyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=O)OC2=C1C=CC(=C2)NC(=O)C3=C(C4=C(S3)N=CN(C4=O)C)C

DOS

IR

Vibrations