Geometry & MOs

Info

ID:	270327
PubChem CID:	103636061
Reduced:	SO2N4C11H12 (1)
Stoich.:	AB2C4D11E12 (1)
Weight, g/mol:	316.159849
ΔH_f, kcal/mol:	40.71
Dipole, Da:	7.97
IP(EA), eV:	-9.58(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[[4-(difluoromethoxy)phenyl]methylamino]ethyl]carbamate

Drug info:

PubChemData

Smile

CC1=NC(=CS1)CCNC2=C(C=NC=C2)[N+](=O)[O-]

DOS

IR

Vibrations