Geometry & MOs

Info

ID:	30443
PubChem CID:	841343
Reduced:	NOSC15H21 (1)
Stoich.:	ABCD15E21 (1)
Weight, g/mol:	276.183778
ΔH_f, kcal/mol:	-40.97
Dipole, Da:	4.24
IP(EA), eV:	-9.35(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-tert-butylcyclohexylidene)amino]-2-methylfuran-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(S1)C(=O)N[C@@H](C)[C@@H]2C[C@@H]3CC[C@H]2C3

DOS

IR

Vibrations