Geometry & MOs

Info

ID:	390282
PubChem CID:	134998269
Reduced:	NOSC20H27 (1)
Stoich.:	ABCD20E27 (1)
Weight, g/mol:	362.166414
ΔH_f, kcal/mol:	5.37
Dipole, Da:	2.06
IP(EA), eV:	-8.11(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-N-[(3-methoxy-4,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)sulfanyl]-1-(4-nitrophenyl)ethanimine

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(C2S/N=C/C=C/C3=CC=CC=C3)OC)C)C

DOS

IR

Vibrations